N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-benzylsulfonyl-N-(5-butyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)CCS(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O3S2/c1-2-3-9-15-18-19-16(23-15)17-14(20)10-11-24(21,22)12-13-7-5-4-6-8-13/h4-8H,2-3,9-12H2,1H3,(H,17,19,20)